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At least 1,099 records · Page 61
All sourcesNASA NTRSDOE OSTI
DOE OSTI2016

SU-G-TeP2-07: Dosimetric Characterization of a New HDR Multi-Channel Esophageal Applicator for Brachytherapy

Purpose: To characterize the dose distribution of a new multi-channel esophageal applicator for brachytherapy HDR treatment, and particularly the effect of the presence of air or water in the applicator’s expansion balloon. Methods: A new multi-channel (6) inflatable applicator for esophageal HDR has been developed in house and tested in a simple water phantom. CT image sets were obtained under several balloon expansions (80ml of air, 50 cc of water), and channel loadings and used with the Oncentra (Elekta) planning system based on TG43 formalism. 400 cGy was prescribed to a plane 1cm away from the applicator. Planar dose distributions were measured for that plane and one next to the applicator using Gafchromic EBT3 film and scanned by a Vidar VXR-12 film digitizer. Film and TPS generated dose distributions of film were sent to OmniPro I’mRT (iba DOSIMETRY) for analysis. 2D dose profiles in both X and Y directions were compared and gamma analysis performed. Results: Film dose measurement of the air-inflated applicator is lower than the TPS calculated dose by as much as 60%. Only 80.8% of the pixels passed the gamma criteria (3%/3mm). For the water-inflated applicator, the measured film dose is fairly close to the TPS calculated dose (typically within <3%). 99.84% of the pixels passed the gamma criteria (3%/3mm). Conclusion: TG43 based calculations worked well when water was used in the expansion balloon. However, when air is present in that balloon, the neglect of heterogeneity corrections in the TG43 calculation results in large differences between calculated and measured doses. This could result in severe underdosing when used in a patient. This study illustrates the need for a TPS with an advanced algorithm which can account for heterogeneity. Supported by Innovations Department, Cleveland Clinic.

60 APPLIED LIFE SCIENCES↗
DOE OSTI2016

TH-CD-BRA-09: Towards Absolute Dose Measurement in MRI-Linac and Gamma-Knife: Design and Construction of An MR-Compatible Water Calorimeter

Purpose: The purpose of this work is to design and optimize a portable Water Calorimeter (WC) for use in a commercial MRI-linac and Gamma-knife in addition to conventional radiotherapy linacs. Water calorimeters determine absorbed dose to water at a point by measuring radiation-induced temperature rise of the volume (the two are related by the medium specific heat capacity). In this formalism, one important correction factor is heat transfer correction k-ht. It compensates for heat gain/loss due to conductive and convective effects, and is numerically calculated as ratio of temperature rise in the absence of heat loss to that in the presence of heat loss. Operating at 4°C ensures convection is minimal. Methods: A commercial finite element software was used to evaluate several WC designs with different insulation materials and thicknesses; channels allowing coolant to travel around WC (to sustain WC at 4°C) were modeled, and worst-case scenario variation in the temperature of the coolant was simulated for optimization purposes (2.6 mK/s). Additionally, several calorimeter vessel design parameters (front/back glass thickness/separation, diameter) were also simulated and optimized. Optimization is based on minimizing long term calorimeter drift (24h) as well as variation and magnitude of k-ht. Results: The final selected WC design reached a modest drift of 11µK/s after 15h for the worst-case coolant temperature variation. This design consists of coolant channels being encompassed on both sides by cryogel insulation. For the MRI-linac beam, glass thickness plays the largest effect on k-ht with variation of upto 0.6% in the first run for thicknesses ranging between 0.5–1.7mm. Subsequent runs vary only within 0.1% with glass thickness. Other factors such as vessel radius and top/bottom glass separation have sub 0.1% effects on k-ht. Conclusion: An MR-safe 4°C stagnant WC appropriate for dosimetry in MRI-linac and Gamma-Knife was designed, optimized, and construction is nearly completed. NSERC Discovery Grant RGPIN-435608.

07 ISOTOPE AND RADIATION SOURCES↗
DOE OSTI2025

$\gamma$-ray angular correlations, distributions and linear polarization in tracking arrays

With $\gamma $-ray tracking arrays, the angular correlation and, especially, the linear polarization of $\gamma $ rays can be measured with high precision. However, because of the complexity of these spectrometers, measuring angular distributions is more involved. The techniques and associated formalisms were developed and established in the 1950s. The experimental setups of that era were relatively simple when compared to the advanced $\gamma $-ray tracking arrays available today. This paper aims to review and refine these techniques, unify the nomenclatures and, specifically, adapt them for use with the newest tracking arrays. In addition, new methods for producing the required response functions for these arrays are introduced.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2021

Performance Evaluation of Comparative Vacuum Monitoring and Piezoelectric Sensors for Structural Health Monitoring of Rotorcraft Components

The costs associated with the increasing maintenance and surveillance needs of aging structures are rising at an unexpected rate. Multi-site fatigue damage, hidden cracks in hard-to-reach locations, disbonded joints, erosion, impact, and corrosion are among the major flaws encountered in today’s extensive fleet of aging aircraft and space vehicles. Aircraft maintenance and repairs represent about a quarter of a commercial fleet’s operating costs. The application of Structural Health Monitoring (SHM) systems using distributed sensor networks can reduce these costs by facilitating rapid and global assessments of structural integrity. The use of in-situ sensors for real-time health monitoring can overcome inspection impediments stemming from accessibility limitations, complex geometries, and the location and depth of hidden damage. Reliable, structural health monitoring systems can automatically process data, assess structural condition, and signal the need for human intervention. The ease of monitoring an entire on-board network of distributed sensors means that structural health assessments can occur more often, allowing operators to be even more vigilant with respect to flaw onset. SHM systems also allow for condition-based maintenance practices to be substituted for the current time-based or cycle-based maintenance approach thus optimizing maintenance labor. The Federal Aviation Administration has conducted a series of SHM validation and certification programs intended to comprehensively support the evolution and adoption of SHM practices into routine aircraft maintenance practices. This report presents one of those programs involving a Sandia Labs-aviation industry effort to move SHM into routine use for aircraft maintenance. The Airworthiness Assurance NDI Validation Center (AANC) at Sandia Labs, in conjunction with Sikorsky, Structural Monitoring Systems Ltd., Anodyne Electronics Manufacturing Corp., Acellent Technologies Inc., and the Federal Aviation Administration (FAA) carried out a trial validation and certification program to evaluate Comparative Vacuum Monitoring (CVM) and Piezoelectric Transducers (PZT) as a structural health monitoring solution to specific rotorcraft applications. Validation tasks were designed to address the SHM equipment, the health monitoring task, the resolution required, the sensor interrogation procedures, the conditions under which the monitoring will occur, the potential inspector population, adoption of CVM and PZT systems into rotorcraft maintenance programs and the document revisions necessary to allow for their routine use as an alternate means of performing periodic structural inspections. This program addressed formal SHM technology validation and certification issues so that the full spectrum of concerns, including design, deployment, performance and certification were appropriately considered. Sandia Labs designed, implemented, and analyzed the results from a focused and statistically relevant experimental effort to quantify the reliability of a CVM system applied to Sikorsky S-92 fuselage frame application and a PZT system applied to an S-92 main gearbox mount beam application. The applications included both local and global damage detection assessments. All factors that affect SHM sensitivity were included in this program: flaw size, shape, orientation and location relative to the sensors, as well as operational and environmental variables. Statistical methods were applied to performance data to derive Probability of Detection (POD) values for SHM sensors in a manner that agrees with current nondestructive inspection (NDI) validation requirements and is acceptable to both the aviation industry and regulatory bodies. The validation work completed in this program demonstrated the ability of both CVM and PZT SHM systems to detect cracks in rotorcraft components. It proved the ability to use final system response parameters to provide a Green Light/Red Light (“GO” – “NO GO”) decision on the presence of damage. In additional to quantifying the performance of each SHM system for the trial applications on the S-92 platform, this study also identified specific methods that can be used to optimize damage detection, guidance on deployment scenarios that can affect performance and considerations that must be made to properly apply CVM and PZT sensors. These results support the main goal of safely integrating SHM sensors into rotorcraft maintenance programs. Additional benefits from deploying rotorcraft Health and Usage Monitoring Systems (HUMS) may be realized when structural assessment data, collected by an SHM system, is also used to detect structural damage to compliment the operational environment monitoring. The use of in-situ sensors for health monitoring of rotorcraft structures can be a viable option for both flaw detection and maintenance planning activities. This formal SHM validation will allow aircraft manufacturers and airlines to confidently make informed decisions about the proper utilization of CVM and PZT technology. It will also streamline future regulatory actions and formal certification measures needed to assure the safe application of SHM solutions.

42 ENGINEERING↗
DOE OSTI2025

SF6 / Acetone Separation & Purification

Sulfur hexafluoride (SF₆) is recognized as the most potent greenhouse gas used in the power transmission and semiconductor sectors. In the past decade, its global emissions have increased sharply, largely due to the absence of effective disposal and recovery pathways. This concern was formally addressed under the Kyoto Protocol, which urged participating nations to adopt measures to limit SF₆ emissions and mitigate its role in climate change. In recent years, various abatement strategies have been explored, including non-thermal plasma (NTP) technologies such as radio frequency, microwave, dielectric barrier discharge, and electron beam systems. While these methods can decompose SF₆, they also produce hazardous by-products like sulfur oxyfluorides, sulfur dioxide, hydrofluoric acid, and fluorine gas. Because these compounds pose both environmental and health risks, replacing traditional disposal practices with modern, more effective treatment methods has become an urgent priority.

36 MATERIALS SCIENCE↗
DOE OSTI2013

THE BOLOCAM GALACTIC PLANE SURVEY. VIII. A MID-INFRARED KINEMATIC DISTANCE DISCRIMINATION METHOD

We present a new distance estimation method for dust-continuum-identified molecular cloud clumps. Recent (sub-)millimeter Galactic plane surveys have cataloged tens of thousands of these objects, plausible precursors to stellar clusters, but detailed study of their physical properties requires robust distance determinations. We derive Bayesian distance probability density functions (DPDFs) for 770 objects from the Bolocam Galactic Plane Survey in the Galactic longitude range 7. Degree-Sign 5 {<=} l {<=} 65 Degree-Sign . The DPDF formalism is based on kinematic distances, and uses any number of external data sets to place prior distance probabilities to resolve the kinematic distance ambiguity (KDA) for objects in the inner Galaxy. We present here priors related to the mid-infrared absorption of dust in dense molecular regions and the distribution of molecular gas in the Galactic disk. By assuming a numerical model of Galactic mid-infrared emission and simple radiative transfer, we match the morphology of (sub-)millimeter thermal dust emission with mid-infrared absorption to compute a prior DPDF for distance discrimination. Selecting objects first from (sub-)millimeter source catalogs avoids a bias towards the darkest infrared dark clouds (IRDCs) and extends the range of heliocentric distance probed by mid-infrared extinction and includes lower-contrast sources. We derive well-constrained KDA resolutions for 618 molecular cloud clumps, with approximately 15% placed at or beyond the tangent distance. Objects with mid-infrared contrast sufficient to be cataloged as IRDCs are generally placed at the near kinematic distance. Distance comparisons with Galactic Ring Survey KDA resolutions yield a 92% agreement. A face-on view of the Milky Way using resolved distances reveals sections of the Sagittarius and Scutum-Centaurus Arms. This KDA-resolution method for large catalogs of sources through the combination of (sub-)millimeter and mid-infrared observations of molecular cloud clumps is generally applicable to other dust-continuum Galactic plane surveys.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2015

Dosimetric characterization of two radium sources for retrospective dosimetry studies

Purpose: During the first part of the 20th century, {sup 226}Ra was the most used radionuclide for brachytherapy. Retrospective accurate dosimetry, coupled with patient follow up, is important for advancing knowledge on long-term radiation effects. The purpose of this work was to dosimetrically characterize two {sup 226}Ra sources, commonly used in Sweden during the first half of the 20th century, for retrospective dose–effect studies. Methods: An 8 mg {sup 226}Ra tube and a 10 mg {sup 226}Ra needle, used at Radiumhemmet (Karolinska University Hospital, Stockholm, Sweden), from 1925 to the 1960s, were modeled in two independent Monte Carlo (MC) radiation transport codes: GEANT4 and MCNP5. Absorbed dose and collision kerma around the two sources were obtained, from which the TG-43 parameters were derived for the secular equilibrium state. Furthermore, results from this dosimetric formalism were compared with results from a MC simulation with a superficial mould constituted by five needles inside a glass casing, placed over a water phantom, trying to mimic a typical clinical setup. Calculated absorbed doses using the TG-43 formalism were also compared with previously reported measurements and calculations based on the Sievert integral. Finally, the dose rate at large distances from a {sup 226}Ra point-like-source placed in the center of 1 m radius water sphere was calculated with GEANT4. Results: TG-43 parameters [including g{sub L}(r), F(r, θ), Λ, and s{sub K}] have been uploaded in spreadsheets as additional material, and the fitting parameters of a mathematical curve that provides the dose rate between 10 and 60 cm from the source have been provided. Results from TG-43 formalism are consistent within the treatment volume with those of a MC simulation of a typical clinical scenario. Comparisons with reported measurements made with thermoluminescent dosimeters show differences up to 13% along the transverse axis of the radium needle. It has been estimated that the uncertainty associated to the absorbed dose within the treatment volume is 10%–15%, whereas uncertainty of absorbed dose to distant organs is roughly 20%–25%. Conclusions: The results provided here facilitate retrospective dosimetry studies of {sup 226}Ra using modern treatment planning systems, which may be used to improve knowledge on long term radiation effects. It is surely important for the epidemiologic studies to be aware of the estimated uncertainty provided here before extracting their conclusions.

07 ISOTOPE AND RADIATION SOURCES↗
DOE OSTI2016

Hamilton-Jacobi formalism for inflation with non-minimal derivative coupling

In inflation with nonminimal derivative coupling there is not a conformal transformation to the Einstein frame where calculations are straightforward, and thus in order to extract inflationary observables one needs to perform a detailed and lengthy perturbation investigation. In this work we bypass this problem by performing a Hamilton-Jacobi analysis, namely rewriting the cosmological equations considering the scalar field to be the time variable. We apply the method to two specific models, namely the power-law and the exponential cases, and for each model we calculate various observables such as the tensor-to-scalar ratio, and the spectral index and its running. We compare them with 2013 and 2015 Planck data, and we show that they are in a very good agreement with observations.

79 ASTRONOMY AND ASTROPHYSICS↗
DOE OSTI2013

Discovery of the First Leaking Double-Shell Tank - Hanford Tank 241-AY-102

Full text - Long Abstract. A routine video inspection of the annulus region of double-shell tank 241-A Y-102 in August of 2012 indicated the presence material in the annulus space between the primary and secondary liners. A comparison was made to previous inspections performed in 2006 and 2007. which indicated that a change had occurred. The material was observed at two locations on the floor of the annulus and one location at the top of the annulus region where the primary and secondary top knuckles meet (RPP-ASMT-53793). Subsequent inspections were performed. leading to additional material observed on the floor of the annulus space in a region that had not previously been inspected (WRPS-PER-2012-1363). The annulus Continuous Air Monitor (CAM) was still operational and was not indicating elevated radiation levels in the annulus region. When the camera from the inspections was recovered. it also did not indicate increased radiation above minimum contamination levels (WRPS-PER-2012-1363). A formal leak assessment team was established August 10, 2012 to review tank 241-AY-102 construction and operating histories and to determine whether the material observed in the annulus had resulted from a leak in the primary tank. The team consisted of individuals from Engineering. Base Operations and Environmental Protection. As this was a first-of-its-kind task. a method for obtaining a sample of the material in the annulus was needed. The consistency of the material was unknown.and the location of a majority of the material was not conducive to using the sampling devices that were currently available at Hanford. A subcontractor was tasked with the development fabrication.and testing of a sampling device that would be able to obtain multiple samples from the material on the annulus floor. as well as the material originating from a refractory air-slot near the floor of the annulus space. This sampler would need to be able to collect and dispense the material it collected into a sample jar retrieval device for transportation of the material to the 222-S laboratory on the Hanford site for analysis. The subcontractor agency fabricated a remote underground sampler by modifying off-the-shelf robotics and parts. Limited testing of the sampler was conducted using a mock-up of the tank annulus and one simulated material type -a salt block. The mock-up testing indicated that the sampler would be able to maneuver within the confined space and that the device worked with full functionality. A total of six weeks had passed from initiation to implementation of the new sampler in the 241-AY-102 tank annulus. Initial sample material was obtained from the annulus floor using the Off-Riser Sampler System that has been used at Hanford tor years to obtain material from the primary tanks. This could be used at the location near Riser 83 since the material was collected directly from the annulus floor and not from a location on the wall or behind a pipe, as was needed from the two locations near Riser 90. After obtaining a small sample of the material on the annulus floor.this sampler sustained terminal damage due to conduit pipes it had to transverse in order to collect and recover material from this location. Several issues were also encountered during deployment of the new sampler into the annulus near Riser 90. These included: Difficulty fitting the sampler down the 12-inch riser into the annulus due to a small tolerance in the size of the sampler; Failure of sampler components and functions during deployment including the camera. pneumatics.and bearing seals; Delays in the field due to supporting equipment issues including cables. cameras. and scaffolding; and, Low recovery of sample material obtained for analysis. The complications that occurred during deployment and use of the new sampler during the sampling event ultimately resulted in lower recovery of material from these locations in the annulus than was obtained using the Off-Riser Sampler System and limited the analyses that could be performed for determining the origin of the material. Following completion of the sample analyses and the assessment of its construction history and use. there was a consensus among the leak assessment team members that two of the three materials sampled from the annulus floor region were the result of waste leaking from a breach in the primary tank. The probable leak cause was identified as corrosion at high temperatures in a tank whose containment margins had been reduced due to construction difficulties (RPP-ASMT-53793). A formal Lessons Learned was created concerning designing equipment tor unique purposes under time constraints. This document was published in OPEXShare on May 20. 2013. It highlighted some of the issues that arose with the subcontractor sampler development and provided recommendations to prevent a recurrence should this task need to be performed again in the future. The document can be found at http://msa.hanford.gov/opex/lesson.cfm/2013/5/20/3481/AY-102-Annulus-Sampler-Designing-Equipment-for-Unique-Purposes-under-Time-Constraints/.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗
DOE OSTI2019

Effective mesonic theory for the ’t Hooft model on the lattice

We apply to a lattice version of the ’t Hooft model, QCD in two space–time dimensions for large number of colours, a method recently proposed to obtain an effective mesonic action starting from the fundamental, fermionic one. The idea is to pass from a canonical, operatorial representation, where the low-energy states have a direct physical interpretation in terms of a Bogoliubov vacuum and its corresponding quasiparticle excitations, to a functional, path integral representation, via the formalism of the transfer matrix. In this way we obtain a lattice effective theory for mesons in a self-consistent setting. We also verify that well-known results from other different approaches are reproduced in the continuum limit.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2015

3D RISM theory with fast reciprocal-space electrostatics

The calculation of electrostatic solute-solvent interactions in 3D RISM (“three-dimensional reference interaction site model”) integral equation theory is recast in a form that allows for a computational treatment analogous to the “particle-mesh Ewald” formalism as used for molecular simulations. In addition, relations that connect 3D RISM correlation functions and interaction potentials with thermodynamic quantities such as the chemical potential and average solute-solvent interaction energy are reformulated in a way that calculations of expensive real-space electrostatic terms on the 3D grid are completely avoided. These methodical enhancements allow for both, a significant speedup particularly for large solute systems and a smoother convergence of predicted thermodynamic quantities with respect to box size, as illustrated for several benchmark systems.

71 CLASSICAL AND QUANTUM MECHANICS, GENERAL PHYSIC↗
DOE OSTI2024

Multipole responses in fissioning nuclei and their uncertainties

Electromagnetic multipole responses are key inputs to model the structure, decay, and reactions of atomic nuclei. With the introduction of the finite amplitude method (FAM), large-scale calculations of the nuclear linear response in heavy deformed nuclei have become possible. This work provides a detailed study of multipole responses in actinide nuclei with Skyrme energy density functionals. We quantify both systematic and statistical uncertainties induced by the functional parametrization in FAM calculations. We also extend the FAM formalism to perform blocking calculations with the equal filling approximation for odd-mass and odd-odd nuclei, and analyze the impact of blocking configurations on the response. In conclusion, by examining the entire plutonium isotopic chain from the proton to the neutron drip line, we find a large variability of the response with the neutron number and study how it correlates with the deformation of the nuclear ground state.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2021

Dataset from: "Adjoint methods for quasisymmetry of vacuum fields on a surface"

Adjoint methods can speed up stellarator optimisation by providing gradient information more efficiently compared to finite-difference evaluations. Adjoint methods are herein applied to vacuum magnetic fields, with objective functions targeting quasisymmetry and a rotational transform value on a surface. To measure quasisymmetry, a novel way of evaluating approximate flux coordinates on a single flux surface without the assumption of a neighbourhood of flux surfaces is proposed. The shape gradients obtained from the adjoint formalism are evaluated numerically and verified against finite-difference evaluations.

70 PLASMA PHYSICS AND FUSION TECHNOLOGY↗
DOE OSTI2024

Barrier penetration in a discrete-basis formalism

The dynamics of a many-particle system are often modeled by mapping the Hamiltonian into a Schrödinger equation. An alternative approach is to solve the Hamiltonian equations directly in a model space of many-body configurations. In a previous paper the numerical convergence of the two approaches was compared with a simplified treatment of the Hamiltonian representation. Here, we extend the comparison to the nonorthogonal model spaces that would be obtained by the generator-coordinate method. With a suitable choice of the collective-variable grid, a configuration-interaction Hamiltonian can reproduce the Schrödinger dynamics very well. Furthermore, the method as implemented here requires that the barrier height is not much larger than the zero-point energy in the collective coordinates of the configurations.

73 NUCLEAR PHYSICS AND RADIATION PHYSICS↗
DOE OSTI2019

The Applications of Intumescent Technologies in Support of D and D Activities across the DOE Complex - 19599

The development of intumescent technologies to be used as both an excellent means of fire protection and resiliency and as a radioactive fixative, would most definitely benefit the safety of the general public and also the environment. The remediation and safe disposal of radioactive waste is of great important to both national security and the public health, as we carry the responsibility to not develop new ways of mitigating these hazards but also to lay the groundwork for future generations. The overall goal of this research is to enhance the fire resiliency and protection of fixatives and nuclear facilities in support of D and D activities. Specific objectives include: 1) identify and evaluate commercial-off-the-shelf (COTS) intumescent technologies, 2) conduct baseline fire testing of intumescent technologies, 3) develop a set of international standards to meet operational and safety requirements for D and D Technologies. In order to evaluate the above proposed research objectives, the following hypotheses have been postulated. - Select, test, and evaluate the suitability of certain 'near fit' ASTM flammability standards. - Baseline and down-select a set of existing COTS intumescent technologies (coatings and foams) to support D and D problem sets. - Determine feasibility of application methods for use inside a radioactive glovebox and hot cells for D and D purposes. - Develop international testing protocols for adapting the use of intumescent technologies to address needs of the D and D process. The proposed research will primarily take place at FIU-ARC. ARC and SRNL have conducted extensive coordination with the Savannah River Site's (SRS) 235-F PuFF facility personnel to facilitate planning in order to expedite the research and development (R and D) related to this effort. An initial set of documents associated with the specific facility hot cells, including schematics, assessment of the manipulator arms, anticipated particulate sizes of the Pu-238 contamination, an approved tooling list, etc., were formally reviewed and approved for release by the site to ARC. Utilizing these as a foundation, pre-planning for further adaptation of the intumescent technologies and the application during a full-scale cold demo at a hot cell testbed at ARC. One of the primary objectives is the testing and evaluation of the resistance of radiological shielding foams to thermal stressors. This objective was accomplished by conducting a flammability test and incremental temperature test. The goal of the flammability test is to conduct analytical tests to provide a classification for the foams as outlined below in accordance with IEC 60695-11-10. This test method is uniformly accepted throughout the industry as being critical indicators that quantifiably establish the flammability characteristics of plastics. It should be noted that polyurethane is not classified as a plastic, however, they do share similar properties deeming this a near fit test. IEC 60695-11-10:2013 specifies small-scale laboratory test procedures intended to compare the burning behavior of different materials when vertically or horizontally oriented test bar specimens are exposed to a small flame ignition source. Two test methods are described. Method A is a horizontal burning test and is intended to determine the linear burning rate of materials under specific test conditions. Method B is a vertical burning test and is intended to determine whether materials self-extinguish under specific test conditions. The purpose of the incremental temperature testing is to evaluate mass loss and dimensional changes that occurs to the radiological shielding foams when exposed to high temperatures in a muffle furnace. High temperatures often cause materials to undergo physical changes such as swelling or expanding. This is caused by the increase in kinetic energy and atomic and molecular movement.

12 MANAGEMENT OF RADIOACTIVE AND NON-RADIOACTIVE W↗
DOE OSTI2013

Benchmark tests and spin adaptation for the particle-particle random phase approximation

The particle-particle random phase approximation (pp-RPA) provides an approximation to the correlation energy in density functional theory via the adiabatic connection [H. van Aggelen, Y. Yang, and W. Yang, Phys. Rev. A 88, 030501 (2013)]. It has virtually no delocalization error nor static correlation error for single-bond systems. However, with its formal O(N{sup 6}) scaling, the pp-RPA is computationally expensive. In this paper, we implement a spin-separated and spin-adapted pp-RPA algorithm, which reduces the computational cost by a substantial factor. We then perform benchmark tests on the G2/97 enthalpies of formation database, DBH24 reaction barrier database, and four test sets for non-bonded interactions (HB6/04, CT7/04, DI6/04, and WI9/04). For the G2/97 database, the pp-RPA gives a significantly smaller mean absolute error (8.3 kcal/mol) than the direct particle-hole RPA (ph-RPA) (22.7 kcal/mol). Furthermore, the error in the pp-RPA is nearly constant with the number of atoms in a molecule, while the error in the ph-RPA increases. For chemical reactions involving typical organic closed-shell molecules, pp- and ph-RPA both give accurate reaction energies. Similarly, both RPAs perform well for reaction barriers and nonbonded interactions. These results suggest that the pp-RPA gives reliable energies in chemical applications. The adiabatic connection formalism based on pairing matrix fluctuation is therefore expected to lead to widely applicable and accurate density functionals.

37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
DOE OSTI2021

Comparison of two culture methods for the enumeration of Legionella pneumophila from potable water samples

Legionella infections have steadily increased in the United States over the last 20 years, and most of these infections have been attributed to contaminated water. The gold standard for confirmation of Legionella presence in water is culturing with Buffered Charcoal Yeast Extract (BCYE) agar. Following many modifications, this method is still time-consuming, expensive, and can take longer than 10 days for full confirmation. The Legiolert is a newer and simpler culture product that is claimed to be able to quantify Legionella pneumophila in 7 days with high sensitivity and specificity and does not need further confirmation for the presence of L. pneumophila. This study compared the culturability of L. pneumophila occurring in a simulated home plumbing system using both Legiolert and BCYE agar methods. Out of 185 water samples, Legiolert and BCYE method detected L. pneumophila in 83 and 85% of the samples, respectively. The two methods were determined to be statistically equivalent for culturability of L. pneumophila, though the detected levels by Legiolert were slightly higher than the BCYE method. The molecular confirmation of positive (n = 254) and negative wells (n = 82) with Legiolert also showed a high specificity of 96.5% (i.e., 3.5% false positives (9/254) and 0% false negatives (0/82)).

Boczek, Laura A.↗
DOE OSTI2023

Evanescent operators in one-loop matching computations

Effective Field Theory calculations used in countless phenomenological analyses employ dimensional regularization, and at intermediate stages of computations, the operator bases extend beyond the four-dimensional ones. The extra pieces — the evanescent operators — can ultimately be removed with a suitable renormalization scheme, resulting in a finite shift of the physical operators. Modern Effective Field Theory matching techniques relying on the method of expansion by regions have to be extended to account for this. After illustrating the importance of these shifts in two specific examples, we compute the finite shifts required to remove all evanescent operators appearing in the one-loop matching of generic ultraviolet theories to the Standard Model Effective Field Theory and elucidate the formalism for generic Effective Field Theory calculations.

72 PHYSICS OF ELEMENTARY PARTICLES AND FIELDS↗